⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL3408570 | 1.00 | — | — | |
| SCHEMBL11631041 | 1.00 | — | — | |
| SCHEMBL28173408 | 1.00 | — | — | |
| SCHEMBL7068760 | 1.00 | — | — | |
| SCHEMBL11633001 | 1.00 | — | — | |
| SCHEMBL10388761 | 1.00 | — | — | |
| SCHEMBL11629843 | 1.00 | — | — | |
| Fluoride SCHEMBL23065011 | 0.82 | — | — | |
| Iodide SCHEMBL2872084 | 0.82 | — | — | |
| SCHEMBL1361568 | 0.82 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7531317-B2 | Fluorescence polarization assay to detect protease cleavage | WISCONSIN ALUMNI RESEARCH FOUNDATION (US) | 2009-05-12 | — | — | US | disclosed |
| US-20050227306-A1 | Fluorescence polarization assay to detect protease cleavage | NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR | 2005-10-13 | — | — | US | disclosed |